Geometry & MOs

Info

ID:	95590
PubChem CID:	50010563
Reduced:	O3N4C26H34 (1)
Stoich.:	A3B4C26D34 (1)
Weight, g/mol:	510.28422
ΔH_f, kcal/mol:	-107.79
Dipole, Da:	4.25
IP(EA), eV:	-8.95(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[5-(diethylcarbamoyl)-2-methylanilino]-2-oxoethyl]-N-(2,4-dimethoxyphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=CC(=C(C=C1)C)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations